1-(8-phenoxyoctyl)-3-pyridin-4-yl-thiourea

Systemtic Name: 1-(8-phenoxyoctyl)-3-pyridin-4-yl-thiourea Openeye Name: 1-(8-phenoxyoctyl)-3-(4-pyridyl)thiourea CAS Name: 1-(8-phenoxyoctyl)-3-pyridin-4-ylthiourea IUPAC Name: 1-(8-phenoxyoctyl)-3-pyridin-4-ylthiourea Traditional Name: 1-(8-phenoxyoctyl)-3-(4-pyridyl)thiourea Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCCCCCNC(=S)NC2=CC=NC=C2

Isomeric SMILES

C1=CC=C(C=C1)OCCCCCCCCNC(=S)NC2=CC=NC=C2

InChI

InChI=1S/C20H27N3OS/c25-20(23-18-12-15-21-16-13-18)22-14-8-3-1-2-4-9-17-24-19-10-6-5-7-11-19/h5-7,10-13,15-16H,1-4,8-9,14,17H2,(H2,21,22,23,25)